1-methyl-3-[(2-piperidin-1-ylsulfonylphenyl)methyl]-1-[[4-(trifluoromethyl)phenyl]methyl]urea

Systemtic Name: 1-methyl-3-[(2-piperidin-1-ylsulfonylphenyl)methyl]-1-[[4-(trifluoromethyl)phenyl]methyl]urea Openeye Name: 1-methyl-3-[[2-(1-piperidylsulfonyl)phenyl]methyl]-1-[[4-(trifluoromethyl)phenyl]methyl]urea CAS Name: 1-methyl-3-[[2-(1-piperidinylsulfonyl)phenyl]methyl]-1-[[4-(trifluoromethyl)phenyl]methyl]urea IUPAC Name: 1-methyl-3-[(2-piperidin-1-ylsulfonylphenyl)methyl]-1-[[4-(trifluoromethyl)phenyl]methyl]urea Traditional Name: 1-methyl-3-(2-piperidinosulfonylbenzyl)-1-[4-(trifluoromethyl)benzyl]urea Formula: C22H26F3N3O3S MolecularWeight: 469.52035

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(F)(F)F)C(=O)NCC2=CC=CC=C2S(=O)(=O)N3CCCCC3

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(F)(F)F)C(=O)NCC2=CC=CC=C2S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H26F3N3O3S/c1-27(16-17-9-11-19(12-10-17)22(23,24)25)21(29)26-15-18-7-3-4-8-20(18)32(30,31)28-13-5-2-6-14-28/h3-4,7-12H,2,5-6,13-16H2,1H3,(H,26,29)